KNApSAcK Metabolite C00037980
Metabolite
KNApSAcK Entry
| id | C00037980 |
|---|---|
| Name | Vaticanol A |
| CAS RN | 287101-82-0 |
| Standard InChI | InChI=1S/C42H32O9/c43-23-7-1-19(2-8-23)33-35(22-13-26(46)15-27(47)14-22)38-31(50)18-32-39-37(42(51-32)21-5-11-25(45)12-6-21)29-16-28(48)17-30(49)36(29)34(40(33)41(38)39)20-3-9-24(44)10-4-20/h1-18,33-35,37,40,42-50H/t33-,34-,35-,37-,40+,42+/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C42H32O9/c43-23-7-1-19(2-8-23)33-35(22-13-26(46)15-27(47)14-22)38-31(50)18-32-39-37(42(51-32)21-5-11-25(45)12-6-21)29-16-28(48)17-30(49)36(29)34(40(33)41(38)39)20-3-9-24(44)10-4-20/h1-18,33-35,37,40,42-50H |
Cluster
| Phytochemical cluster | No. 30 |
|---|---|
| KCF-S cluster | No. 163 |
Link
ChEMBL
| By standard InChI | CHEMBL508745 |
|---|---|
| By standard InChI Main Layer | CHEMBL504167 CHEMBL508745 CHEMBL601291 CHEMBL1939428 |
KEGG
| By LinkDB |
|---|
CTD
| By CAS RN |
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Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 1 |
Family
| family name | count |
|---|---|
| Dipterocarpaceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Vatica rassak | 64579 | Dipterocarpaceae | rosids | Viridiplantae |